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Trp-P-2 Acetate

UUID 08a91e70-3ddc-11dd-9a44-0050c2490048
Flow Object IDfo-5c78105c21696f2a
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 72254-58-1
prefLabel
Language Value Provenance
en Trp-P-2 Acetate
altLabel
Language Value Provenance
en 1-Methyl-2<em>H</em>-pyrido[4,3-<em>b</em>]indol-3(5<em>H</em>)-imine acetate
en 3-Amino-1-methyl-5<em>H</em>-pyrido[4,3-<em>b</em>]indole acetate
en 3-Amino-1-methyl-5<em>H</em>-pyrido[4,3-<em>b</em>]indole acetic acid salt
en 5<em>H</em>-Pyrido[4,3-<em>b</em>]indol-3-amine, 1-methyl-, acetate (1:1)
en 5<em>H</em>-Pyrido[4,3-<em>b</em>]indol-3-amine, 1-methyl-, monoacetate
References
Shared Properties
Predicate Value
InChIKey AASZBFHIHXZWRI-UHFFFAOYSA-N, LKKMLIBUAXYLOY-UHFFFAOYSA-N, UXNRBAJNAWIPGF-BGRRMDFBSA-N
InChI InChI=1S/C12H11N3.C2H4O2/c1-7-12-8-4-2-3-5-9(8)15-10(12)6-11(13)14-7;1-2(3)4/h2-6,15H,1H3,(H2,13,14);1H3,(H,3,4), InChI=1S/C12H11N3/c1-7-12-8-4-2-3-5-9(8)15-10(12)6-11(13)14-7/h2-6,15H,1H3,(H2,13,14), InChI=1S/C13H13N3.C2H4O2/c1-7-12-11(8(2)15-13(7)14)9-5-3-4-6-10(9)16-12;1-2(3)4/h3-6,16H,1-2H3,(H2,14,15);1H3,(H,3,4)/i13+2;
IUPAC name (1-methyl-5H-pyrid[4,3-b]indol-3-yl)amine, 1,4-dimethyl-5H-(614C)pyridino[4,3-b]indol-3-amine;ethanoic acid, 1-methyl-5H-pyrido[4,3-b]indol-3-amine, acetic acid;(1,4-dimethyl-5H-(614C)pyridin[4,3-b]indol-3-yl)amine, acetic acid;(1-methyl-5H-pyrid[4,3-b]indol-3-yl)amine, acetic acid;1,4-dimethyl-5H-(614C)pyridino[4,3-b]indol-3-amine, acetic acid;1-methyl-5H-pyrido[4,3-b]indol-3-amine, ethanoic acid;1-methyl-5H-pyrido[4,3-b]indol-3-amine
Molecular formula C12H11N3, C14H15N3O2, C15H17N3O2
SMILES CC1=C2C(=C(N=C1N)C)C3=CC=CC=C3N2.CC(=O)O, CC1=C2C(=C(N=[14C]1N)C)C3=CC=CC=C3N2.CC(=O)O, CC1=C2C3=CC=CC=C3NC2=CC(=N1)N, CC1=C2C3=CC=CC=C3NC2=CC(=N1)N.CC(=O)O

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 08a91e70-3ddc-11dd-9a44-0050c2490048 Trp-P-2 acetate

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 Trp-P-2 acetate Emissions/Emissions to water/Emissions to water, unspecified kg exactMatch

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field Change Count Latest Time Transformers Latest Comment
altLabel 1 consensus_match group_key=trp-p-2acetate||dimension=Environmental > media=Water > water_body=Unknown; cas=72254-58-1; added Common Chemistry CAS names as altLabel: 1-Methyl-2<em>H</em>-pyrido[4,3-<em>b</em>]indol-3(5<em>H</em>)-imine acetate, 3-Amino-1-methyl-5<em>H</em>-pyrido[4,3-<em>b</em>]indole acetate, 3-Amino-1-methyl-5<em>H</em>-pyrido[4,3-<em>b</em>]indole acetic acid salt, 5<em>H</em>-Pyrido[4,3-<em>b</em>]indol-3-amine, 1-methyl-, acetate (1:1), 5<em>H</em>-Pyrido[4,3-<em>b</em>]indol-3-amine, 1-methyl-, monoacetate; object_uuid=fo-5c78105c21696f2a
cas_match_labels 1 consensus_match group_key=trp-p-2acetate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=[]; cas_sources={'72254-58-1': []}; assigned CAS labels from group consensus; object_uuid=fo-5c78105c21696f2a: {'72254-58-1': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '1-Methyl-2<em>H</em>-pyrido[4,3-<em>b</em>]indol-3(5<em>H</em>)-imine acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:72254-58-1', 'https://commonchemistry.cas.org/detail?cas_rn=72254-58-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3-Amino-1-methyl-5<em>H</em>-pyrido[4,3-<em>b</em>]indole acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:72254-58-1', 'https://commonchemistry.cas.org/detail?cas_rn=72254-58-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3-Amino-1-methyl-5<em>H</em>-pyrido[4,3-<em>b</em>]indole acetic acid salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:72254-58-1', 'https://commonchemistry.cas.org/detail?cas_rn=72254-58-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '5<em>H</em>-Pyrido[4,3-<em>b</em>]indol-3-amine, 1-methyl-, acetate (1:1)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:72254-58-1', 'https://commonchemistry.cas.org/detail?cas_rn=72254-58-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '5<em>H</em>-Pyrido[4,3-<em>b</em>]indol-3-amine, 1-methyl-, monoacetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:72254-58-1', 'https://commonchemistry.cas.org/detail?cas_rn=72254-58-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=trp-p-2acetate||dimension=Environmental > media=Water > water_body=Unknown; cas=72254-58-1; added Common Chemistry CAS names as altLabel: 1-Methyl-2<em>H</em>-pyrido[4,3-<em>b</em>]indol-3(5<em>H</em>)-imine acetate, 3-Amino-1-methyl-5<em>H</em>-pyrido[4,3-<em>b</em>]indole acetate, 3-Amino-1-methyl-5<em>H</em>-pyrido[4,3-<em>b</em>]indole acetic acid salt, 5<em>H</em>-Pyrido[4,3-<em>b</em>]indol-3-amine, 1-methyl-, acetate (1:1), 5<em>H</em>-Pyrido[4,3-<em>b</em>]indol-3-amine, 1-methyl-, monoacetate; object_uuid=fo-5c78105c21696f2a
cas_match_labels None {'72254-58-1': 'exactMatch'} group_key=trp-p-2acetate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=[]; cas_sources={'72254-58-1': []}; assigned CAS labels from group consensus; object_uuid=fo-5c78105c21696f2a: {'72254-58-1': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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